In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 13 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -0.30 | 1.48 | -31.51 | 3 | 3 | 1 | 34 | 184.307 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.30 | -0.51 | -41.29 | 3 | 3 | 1 | 34 | 184.307 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.30 | 1.87 | -87.77 | 4 | 3 | 2 | 35 | 185.315 | 3 | ↓ |